9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran

C175H114O — CID 160716890

About 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran

9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran (PubChem CID 160716890) has the molecular formula C175H114O and a molecular weight of 2232.84 g/mol. Its IUPAC name is 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran.

Molecular Properties

• Compound Name: 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran
• PubChem CID: 160716890
• Molecular Formula: C175H114O
• Molecular Weight: 2232.84 g/mol
• Exact Mass: 2230.89
• IUPAC Name: 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5ccccc5)cc34)cc21.c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5cccc6ccccc56)ccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)ccc2c1
• InChI: InChI=1S/C45H32.2C44H28.C42H26O/c1-45(2)41-22-11-10-18-34(41)35-25-24-32(28-42(35)45)43-37-19-8-9-20-38(37)44(36-21-12-16-30-15-6-7-17-33(30)36)39-26-23-31(27-40(39)43)29-13-4-3-5-14-29;1-3-13-32-26-35(22-20-29(32)10-1)43-39-17-7-8-18-40(39)44(36-23-21-30-11-2-4-14-33(30)27-36)42-28-34(24-25-41(42)43)38-19-9-15-31-12-5-6-16-37(31)38;1-2-14-32-27-34(24-23-29(32)11-1)43-39-19-7-8-20-40(39)44(38-22-10-16-31-13-4-6-18-36(31)38)41-26-25-33(28-42(41)43)37-21-9-15-30-12-3-5-17-35(30)37;1-2-11-27(12-3-1)29-21-23-36-38(25-29)41(30-22-24-40-37(26-30)32-16-8-9-20-39(32)43-40)34-17-6-7-18-35(34)42(36)33-19-10-14-28-13-4-5-15-31(28)33/h3-28H,1-2H3;2*1-28H;1-26H
• InChIKey: RSOXDKKCJUMMMY-UHFFFAOYSA-N
• XLogP: 49.41
• TPSA: 13.14 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 12
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2232.84
LogP ≤ 5	49.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran?

The IUPAC name of 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran (CID 160716890) is 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran.

What is the SMILES notation for 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran?

The canonical SMILES for 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran is CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5ccccc5)cc34)cc21.c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5cccc6ccccc56)ccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)ccc2c1.

What is the InChIKey of 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran?

The InChIKey is RSOXDKKCJUMMMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H32.2C44H28.C42H26O/c1-45(2)41-22-11-10-18-34(41)35-25-24-32(28-42(35)45)43-37-19-8-9-20-38(37)44(36-21-12-16-30-15-6-7-17-33(30)36)39-26-23-31(27-40(39)43)29-13-4-3-5-14-29;1-3-13-32-26-35(22-20-29(32)10-1)43-39-17-7-8-18-40(39)44(36-23-21-30-11-2-4-14-33(30)27-36)42-28-34(24-25-41(42)43)38-19-9-15-31-12-5-6-16-37(31)38;1-2-14-32-27-34(24-23-29(32)11-1)43-39-19-7-8-20-40(39)44(38-22-10-16-31-13-4-6-18-36(31)38)41-26-25-33(28-42(41)43)37-21-9-15-30-12-3-5-17-35(30)37;1-2-11-27(12-3-1)29-21-23-36-38(25-29)41(30-22-24-40-37(26-30)32-16-8-9-20-39(32)43-40)34-17-6-7-18-35(34)42(36)33-19-10-14-28-13-4-5-15-31(28)33/h3-28H,1-2H3;2*1-28H;1-26H.

What are the key properties of 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran?

9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran has a molecular weight of 2232.84 g/mol, XLogP of 49.41, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-yl-2-phenylanthracene;2,10-dinaphthalen-1-yl-9-naphthalen-2-ylanthracene;2-naphthalen-1-yl-9,10-dinaphthalen-2-ylanthracene;2-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)dibenzofuran is sourced from PubChem (CID 160716890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).